N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-5-[rel-(4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Chemical Structure Depiction of
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-5-[rel-(4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-5-[rel-(4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Compound characteristics
| Compound ID: | Y043-4004 |
| Compound Name: | N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-5-[rel-(4R,6aS)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C20 H25 F N4 O2 S |
| Smiles: | C(CC[C@H]1C2[C@H](CS1)NC(N2)=O)CC(NCCc1c[nH]c2ccc(cc12)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9381 |
| logD: | 1.9381 |
| logSw: | -2.5443 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 71.813 |
| InChI Key: | AHBMLSFVCCOQNS-FQZXCLDYSA-N |